1-ethenyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid

1-ethenyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid

CAS: 340023-04-3

Formula: C10H14O3

SMILES: OC(=O)C12CCC(CC1)(OC2)C=C

IUPAC: 1-ethenyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid

InChI: InChI=1S/C10H14O3/c1-2-10-5-3-9(4-6-10,7-13-10)8(11)12/h2H,1,3-7H2,(H,11,12)

Composition: C (65.92%), H (7.74%), O (26.34%)

Molar Mass: 182.219

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	182.094294311
Formal Charge	0
FSP3	0.7
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XMFZIWBHEVCVRV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.33
Topological Polar Surface Area	46.53
Polarizability	18.68
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	340023-04-3		$272.38-$1,121.03$272.38$436.31$749.03$1,121.03